4-(4-Hydroxy-benzenesulfonyl)-thiophene-2-sulfonic acid amide

Base Information

Chemical Name:4-(4-Hydroxy-benzenesulfonyl)-thiophene-2-sulfonic acid amide
CAS No.:128348-42-5
Molecular Formula:C10H9NO5S3
Molecular Weight:319.383
Hs Code.:
ChEMBL ID:CHEMBL341530
DSSTox Substance ID:DTXSID10872215
Nikkaji Number:J513.638E
Pharos Ligand ID:F4KVD74FH5NU
Mol file:128348-42-5.mol

Synonyms:CHEMBL341530;128348-42-5;DTXSID10872215;BDBM50003251;4-(4-Hydroxybenzene-1-sulfonyl)thiophene-2-sulfonamide;4-(4-Hydroxy-benzenesulfonyl)-thiophene-2-sulfonic acid amide

Suppliers and Price of 4-(4-Hydroxy-benzenesulfonyl)-thiophene-2-sulfonic acid amide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 4-(4-Hydroxy-benzenesulfonyl)-thiophene-2-sulfonic acid amide

Chemical Property:

XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:318.96428591
Heavy Atom Count:19
Complexity:510

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1O)S(=O)(=O)C2=CSC(=C2)S(=O)(=O)N

Technology Process of 4-(4-Hydroxy-benzenesulfonyl)-thiophene-2-sulfonic acid amide

There total 5 articles about 4-(4-Hydroxy-benzenesulfonyl)-thiophene-2-sulfonic acid amide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 82.0%

: 119731-18-9
4-(4-Methoxyphenylsulfonyl)thiophene-2-sulfonamide

: 128348-42-5
4-(4-Hydroxyphenylsulfonyl)thiophene-2-sulfonamide

Guidance literature:: With boron tribromide; In dichloromethane; 1,2-dichloro-ethane; for 16h; Heating;
DOI:10.1002/jhet.5570270202 DOI:10.1021/jm00099a010

Reference yield:

: 5335-87-5
4,4'-dimethoxyphenyl disulfide

: 128348-42-5
4-(4-Hydroxyphenylsulfonyl)thiophene-2-sulfonamide

Guidance literature:: Multi-step reaction with 5 steps

1: 1.) n-butyllithium / 1.) ether, hexane, -78 deg C, 45 min, 2.) ether, hexane, from -78 deg C to RT, overnight

2: m-chloroperbenzoic acid (MCPBA) / CHCl₃ / 1.5 h / 0 - 10 °C

3: chlorosulfonic acid, PCl₅ / 0.42 h / 55 °C

4: NH₃ (gas) / CHCl₃ / 16 h / Ambient temperature

5: 82 percent / boron tribromide / 1,2-dichloro-ethane; CH₂Cl₂ / 16 h / Heating

With chlorosulfonic acid; n-butyllithium; phosphorus pentachloride; ammonia; boron tribromide; 3-chloro-benzenecarboperoxoic acid; In dichloromethane; chloroform; 1,2-dichloro-ethane;
DOI:10.1021/jm00099a010

Reference yield:

: 128348-25-4
3-(4-Methoxyphenylsulfonyl)thiophene

: 128348-42-5
4-(4-Hydroxyphenylsulfonyl)thiophene-2-sulfonamide

Guidance literature:: Multi-step reaction with 3 steps

1: chlorosulfonic acid, PCl₅ / 0.42 h / 55 °C

2: NH₃ (gas) / CHCl₃ / 16 h / Ambient temperature

3: 82 percent / boron tribromide / 1,2-dichloro-ethane; CH₂Cl₂ / 16 h / Heating

With chlorosulfonic acid; phosphorus pentachloride; ammonia; boron tribromide; In dichloromethane; chloroform; 1,2-dichloro-ethane;
DOI:10.1021/jm00099a010